N-[[1-(2-methoxyphenyl)cyclopropyl]methyl]pyrrolidine-1-carboxamide

C16H22N2O2 — CID 60612311

IUPACN-[[1-(2-methoxyphenyl)cyclopropyl]methyl]pyrrolidine-1-carboxamide
SMILESCOc1ccccc1C1(CNC(=O)N2CCCC2)CC1
InChIInChI=1S/C16H22N2O2/c1-20-14-7-3-2-6-13(14)16(8-9-16)12-17-15(19)18-10-4-5-11-18/h2-3,6-7H,4-5,8-12H2,1H3,(H,17,19)
InChIKeyYONTXERQWKYJOD-UHFFFAOYSA-N
MW274.36 g/mol
LogP2.53
Rot. Bonds4

About N-[[1-(2-methoxyphenyl)cyclopropyl]methyl]pyrrolidine-1-carboxamide

N-[[1-(2-methoxyphenyl)cyclopropyl]methyl]pyrrolidine-1-carboxamide (PubChem CID 60612311) has the molecular formula C16H22N2O2 and a molecular weight of 274.36 g/mol. Its IUPAC name is N-[[1-(2-methoxyphenyl)cyclopropyl]methyl]pyrrolidine-1-carboxamide.

Molecular Properties

Compound NameN-[[1-(2-methoxyphenyl)cyclopropyl]methyl]pyrrolidine-1-carboxamide
PubChem CID60612311
Molecular FormulaC16H22N2O2
Molecular Weight274.36 g/mol
Exact Mass274.17
IUPAC NameN-[[1-(2-methoxyphenyl)cyclopropyl]methyl]pyrrolidine-1-carboxamide
SMILESCOc1ccccc1C1(CNC(=O)N2CCCC2)CC1
InChIInChI=1S/C16H22N2O2/c1-20-14-7-3-2-6-13(14)16(8-9-16)12-17-15(19)18-10-4-5-11-18/h2-3,6-7H,4-5,8-12H2,1H3,(H,17,19)
InChIKeyYONTXERQWKYJOD-UHFFFAOYSA-N
XLogP2.53
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.36
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-hydroxy-N-[[1-(2-methoxyphenyl)cyclopentyl]methyl]piperidine-1-carboxamide
CID 110903329
methyl N-[[1-(2-methoxyphenyl)cyclobutyl]methyl]carbamate
CID 110477745
N-[[1-(2-methoxyphenyl)cyclobutyl]methyl]-2-oxopropanamide
CID 110478355
N-[[1-(2-methoxyphenyl)cyclobutyl]methyl]propanamide
CID 110441312
(2R)-1-(cyclopropanecarbonyl)-N-[[1-(2-methoxyphenyl)cyclopropyl]methyl]pyrrolidine-2-carboxamide
CID 97211501
1-[[1-(2-methoxyphenyl)cyclopropyl]methyl]-3-(2-methylpropyl)urea
CID 60612371
1-[[1-(2-methoxyphenyl)cyclobutyl]methyl]-3-phenylurea
CID 110446753
(3S)-N-[[1-(2-methoxyphenyl)cyclopentyl]methyl]-3-methylmorpholine-4-carboxamide
CID 94572560
2-(2-methoxyphenyl)-N-[[1-(2-methoxyphenyl)cyclobutyl]methyl]acetamide
CID 110446469
N-[(2-methoxyphenyl)methyl]pyrrolidine-1-carboxamide
CID 38150329
1-cyclobutyl-3-[[1-(2-methoxyphenyl)cyclopropyl]methyl]-1-methylurea
CID 84585180
methyl 1-[N-[[1-(2-methoxyphenyl)cyclopentyl]methyl]-N'-methylcarbamimidoyl]piperidine-4-carboxylate;hydroiodide
CID 111253426

Frequently Asked Questions

What is the IUPAC name of N-[[1-(2-methoxyphenyl)cyclopropyl]methyl]pyrrolidine-1-carboxamide?
The IUPAC name of N-[[1-(2-methoxyphenyl)cyclopropyl]methyl]pyrrolidine-1-carboxamide (CID 60612311) is N-[[1-(2-methoxyphenyl)cyclopropyl]methyl]pyrrolidine-1-carboxamide.
What is the SMILES notation for N-[[1-(2-methoxyphenyl)cyclopropyl]methyl]pyrrolidine-1-carboxamide?
The canonical SMILES for N-[[1-(2-methoxyphenyl)cyclopropyl]methyl]pyrrolidine-1-carboxamide is COc1ccccc1C1(CNC(=O)N2CCCC2)CC1.
What is the InChIKey of N-[[1-(2-methoxyphenyl)cyclopropyl]methyl]pyrrolidine-1-carboxamide?
The InChIKey is YONTXERQWKYJOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O2/c1-20-14-7-3-2-6-13(14)16(8-9-16)12-17-15(19)18-10-4-5-11-18/h2-3,6-7H,4-5,8-12H2,1H3,(H,17,19).
What are the key properties of N-[[1-(2-methoxyphenyl)cyclopropyl]methyl]pyrrolidine-1-carboxamide?
N-[[1-(2-methoxyphenyl)cyclopropyl]methyl]pyrrolidine-1-carboxamide has a molecular weight of 274.36 g/mol, XLogP of 2.53, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(2-methoxyphenyl)cyclopropyl]methyl]pyrrolidine-1-carboxamide is sourced from PubChem (CID 60612311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).